SCHEMBL5578085

SCHEMBL5578085

c1ccc(CNCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.65
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
CACNA1G O43497 2/20 0.54
ATM Q13315 1/20 0.54
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.51
OPRM1 P35372 2/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
CHRM5 P08912 1/20 0.50
ADRA2A P08913 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
CYP2D6 P10635 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
DRD1 P21728 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9251307 0.80 OPRM1 (0.59) MEN1KMT2ANPSR1LMNAMAPK1
SCHEMBL10725956 0.79 LMNA (0.56) KMT2ANPSR1ATMLMNAMAPK1
SCHEMBL5756091 0.79 DPP7 (1.00) DPP7MEN1KMT2ACYP2D6DRD3
SCHEMBL8637097 0.79 MEN1 (0.61) MEN1KMT2ANPSR1ATMMAPK1
Hydrochloric Acid SCHEMBL5754930 0.78 DPP7 (0.96) DPP7MEN1KMT2ACYP2D6DRD3
SCHEMBL8883456 0.78 DPP7 (0.96) DPP7MEN1KMT2ACYP2D6DRD3
SCHEMBL10725953 0.78 LMNA (0.57) MEN1KMT2ANPSR1ATMLMNA
SCHEMBL9661431 0.77 ALDH1A1 (0.65) MEN1KMT2ANPSR1ATMLMNA
Hydrochloric Acid SCHEMBL5759171 0.76 DPP7 (0.93) DPP7MEN1KMT2ADRD3SLC6A3
Hydrochloric Acid SCHEMBL5758454 0.76 DPP7 (0.93) DPP7MEN1KMT2ADRD3SLC6A3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232538-A1 Uses of polypeptides TAKEDA PHARMACEUTICAL COMPANY, LTD (JP) 2007-10-04 US disclosed
US-20040063699-A1 Gpr14 antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
US-20040053826-A1 Uses of polypeptides TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-18 US disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 EP disclosed
EP-1308513-A1 USE OF POLYPEPTIDE Takeda Chemical Industries, Ltd. (JP) 2003-05-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070232538-A1 Uses of polypeptides NPSR1, SCTR, GRPR DPP7 1086/4885MEN1 4302/4885KMT2A 2960/4885
US-20040053826-A1 Uses of polypeptides NPSR1, SCTR, GRPR DPP7 1086/4885MEN1 4302/4885KMT2A 2960/4885
US-20040063699-A1 Gpr14 antagonist GPR142, GPR139, GPR4 DPP7 2440/4885MEN1 3436/4885KMT2A 1233/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.